%chk=000002519.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002519

0 1
 O   0.4700000       2.568800      6.0000003E-04
 O   -3.127100     -0.4436000     -3.0000001E-04
 N  -0.9686000      -1.312500       0.000000    
 N    2.218200      0.1412000     -3.0000001E-04
 N   -1.347700       1.079700     -9.9999997E-05
 N    1.411900      -1.937200      1.9999999E-04
 C   0.8579000      0.2592000     -7.9999998E-04
 C   0.3897000      -1.026400     -3.9999999E-04
 C   3.0700000E-02   1.422000     -6.0000003E-04
 C   -1.906100     -0.2495000     -3.9999999E-04
 C    2.503200      -1.199800      3.0000001E-04
 C   -1.427600      -2.696000      7.9999998E-04
 C    3.192600       1.206100      3.0000001E-04
 C   -2.296900       2.188100      6.9999998E-04
 H    3.516300      -1.578700      7.9999998E-04
 H   -1.045100      -3.197300     -0.8937000    
 H   -2.518600      -2.759600      1.1000000E-03
 H   -1.044700      -3.196300      0.8957000    
 H    4.199200      0.7801000      1.9999999E-04
 H    3.046800       1.809200     -0.8992000    
 H    3.046600       1.808300      0.9004000    
 H   -1.808700       3.165100     -3.0000001E-04
 H   -2.932200       2.102700      0.8881000    
 H   -2.934600       2.102100     -0.8849000    


%chk=000002519-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002519

0 1
O 0.418713 2.648217 0.000227
O -3.151537 -0.437780 0.000394
N -0.975590 -1.317567 0.000535
N 2.277924 0.136721 0.000186
N -1.355770 1.070675 0.000483
N 1.410394 -1.984662 0.000455
C 0.879750 0.267201 0.000314
C 0.384355 -1.048313 0.000436
C 0.036371 1.435790 0.000445
C -1.902040 -0.248998 0.000704
C 2.538786 -1.225092 0.000326
C -1.462870 -2.710766 0.000445
C 3.258118 1.234105 0.000124
C -2.354777 2.164357 0.000342
H 3.550315 -1.624610 0.000227
H -1.095765 -3.239598 -0.895047
H -2.562220 -2.677820 0.000577
H -1.095549 -3.239786 0.895736
H 4.272415 0.803234 -0.000638
H 3.123059 1.867977 -0.890938
H 3.124080 1.867212 0.891892
H -1.799642 3.114211 -0.000697
H -2.996064 2.091203 0.893801
H -2.997256 2.089790 -0.892127


